(phenylmethyl) 5-methanoyl-4-(3-methoxy-3-oxidanylidene-propyl)-3-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 5-methanoyl-4-(3-methoxy-3-oxidanylidene-propyl)-3-methyl-1H-pyrrole-2-carboxylate Openeye Name: benzyl 5-formyl-4-(3-methoxy-3-oxo-propyl)-3-methyl-1H-pyrrole-2-carboxylate CAS Name: 5-formyl-4-(3-methoxy-3-oxopropyl)-3-methyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-formyl-4-(3-methoxy-3-oxopropyl)-3-methyl-1H-pyrrole-2-carboxylate Traditional Name: 5-formyl-4-(3-keto-3-methoxy-propyl)-3-methyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CCC(=O)OC)C=O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=C(NC(=C1CCC(=O)OC)C=O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H19NO5/c1-12-14(8-9-16(21)23-2)15(10-20)19-17(12)18(22)24-11-13-6-4-3-5-7-13/h3-7,10,19H,8-9,11H2,1-2H3